Kurt Valentin Mikkelsen

Kurt Valentin Mikkelsen

Professor

Member of:


    1. 2003
    2. Published

      Molecular electric properties of liquid water calculated using the combined coupled cluster/molecular mechanics method

      Kongsted, J., Osted, A. I., Mikkelsen, Kurt Valentin & Christiansen, O., 2003, In: Journal of Molecular Structure: THEOCHEM. 632, p. 207-225

      Research output: Contribution to journalJournal articleResearchpeer-review

    3. Published

      Nonlinear optical response properties of molecules in condensed phases using the coupled cluster/dielectric continuum or molecular mechanics methods

      Kongsted, J., Osted, A. I., Mikkelsen, Kurt Valentin & Christiansen, O., 2003, In: Journal of Chemical Physics. 119, p. 10519-10535

      Research output: Contribution to journalJournal articleResearchpeer-review

    4. Published

      Response theory in the multipole reaction field model for equilibrium and nonequilibrium solvation: Exact theory and the second order polarization propagator approximation

      Nielsen, C. B., Sauer, Stephan P. A. & Mikkelsen, Kurt Valentin, 2003, In: Journal of Chemical Physics. 119, p. 3849-3870

      Research output: Contribution to journalJournal articleResearchpeer-review

    5. Published

      Saturation of the third-order polarizability of carbon nanotubes characterized by a dipole interaction model

      Jensen, L., Åstrand, P. & Mikkelsen, Kurt Valentin, 2003, In: Nano Letters. 3 (5), p. 661-665

      Research output: Contribution to journalJournal articleResearchpeer-review

    6. 2004
    7. Published

      A coupled cluster study of the oriented circular dichroism of the n → π* electronic transition in cyclopropanone and natural optical active related structures

      Kongsted, J., Hansen, A. E., Pedersen, T. B., Osted, A. I., Mikkelsen, Kurt Valentin & Christiansen, O., 2004, In: Chemical Physics Letters. 391, p. 259-266

      Research output: Contribution to journalJournal articleResearchpeer-review

    8. Published

      A theoretical study of the reaction between CH3S(OH)CH3 and O2

      Gross, A., Barnes, I., Sørensen, R. M., Kongsted, J. & Mikkelsen, Kurt Valentin, 2004, In: Journal of Physical Chemistry A. 108, p. 8659-8671

      Research output: Contribution to journalJournal articleResearchpeer-review

    9. Published

      Effect of molecular structure and hydration on the uptake of gas-phase sulfuric acid by charged clusters/ultrafine particles

      Nadykto, A. B., Natsheh, A. A., Yu, F., Mikkelsen, Kurt Valentin & Ruuskanen, J., 2004, In: Aerosol Science and Technology. 38, p. 349-353

      Research output: Contribution to journalJournal articleResearchpeer-review

    10. Published

      Interaction energies between aerosol precursors formed in the photo-oxidation of a-pinene

      Sloth, M., Bilde, M. & Mikkelsen, Kurt Valentin, 2004, In: Molecular Physics. 102, p. 2361-2368

      Research output: Contribution to journalJournal articleResearchpeer-review

    11. Published

      Linear response properties of liquid water calculated using CC2 and CCSD within different molecular mechanics methods

      Osted, A. I., Kongsted, J., Mikkelsen, Kurt Valentin & Christiansen, O., 2004, In: Journal of Physical Chemistry A. 108, p. 8646-8658

      Research output: Contribution to journalJournal articleResearchpeer-review

    12. Published

      Microscopic and macroscopic polarization in C60 fullerene clusters as calculated by an electrostatic interaction model

      Jensen, L., Åstrand, P. & Mikkelsen, Kurt Valentin, 2004, In: Journal of Physical Chemistry B. 108, p. 8226-8233

      Research output: Contribution to journalJournal articleResearchpeer-review

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